SCHEMBL15468159

SCHEMBL15468159

CC(=O)OC1O[C@H](COC(=O)c2ccccc2)C(O)[C@H]1F

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
SYNJ2 O15056 3/20 0.46
HTT P42858 1/20 0.44
SLC22A1 O15245 1/20 0.44
TSHR P16473 1/20 0.43
LMNA P02545 4/20 0.43
TYMP P19971 1/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KMT2A Q03164 1/20 0.40
LGALS9 O00182 1/20 0.39
LGALS1 P09382 1/20 0.39
LGALS3 P17931 1/20 0.39
LGALS7; LGALS7B P47929 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL26287640 0.91 PTPN1 (0.46) ALDH1A1SYNJ2HTTSLC22A1LMNA
SCHEMBL15468167 0.89 TSHR (0.51) ALDH1A1TSHRLMNAPOLBGAA
SCHEMBL6377053 0.88 PTPN1 (0.47) ALDH1A1TSHRLMNAPOLBMAPK1
SCHEMBL5974842 0.88 PTPN1 (0.47) ALDH1A1TSHRLMNAPOLBMAPK1
SCHEMBL5974836 0.88 PTPN1 (0.47) ALDH1A1TSHRLMNAPOLBMAPK1
SCHEMBL7215485 0.88 PTPN1 (0.47) ALDH1A1TSHRLMNAPOLBMAPK1
SCHEMBL4263976 0.88 PTPN1 (0.47) ALDH1A1TSHRLMNAPOLBMAPK1
SCHEMBL6377056 0.88 PTPN1 (0.47) ALDH1A1TSHRLMNAPOLBMAPK1
SCHEMBL22758821 0.88 PTPN1 (0.47) ALDH1A1TSHRLMNAPOLBMAPK1
SCHEMBL7215482 0.88 PTPN1 (0.47) ALDH1A1TSHRLMNAPOLBMAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8648188-B2 Preparation of 2-chloro-9-(2′-deoxy-2′-fluoro-β-D-arabinofuranosyl)-adenine SCINOPHARM TAIWAN, LTD. (TW) 2014-02-11 US disclosed